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2-(1-([1,1'-biphenyl]-4-yl)-2-methylpropyl)-5-chlorothiophene
SpectraBase Compound ID 4wZ6aSGkZhH
InChI InChI=1S/C20H19ClS/c1-14(2)20(18-12-13-19(21)22-18)17-10-8-16(9-11-17)15-6-4-3-5-7-15/h3-14,20H,1-2H3
InChIKey DGOKHTOWUIODOZ-UHFFFAOYSA-N
Mol Weight 326.89 g/mol
Molecular Formula C20H19ClS
Exact Mass 326.089599 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 79iT1L9CX8u
Name 2-(1-([1,1'-biphenyl]-4-yl)-2-methylpropyl)-5-chlorothiophene
Appearance Colourless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H19ClS
InChI InChI=1S/C20H19ClS/c1-14(2)20(18-12-13-19(21)22-18)17-10-8-16(9-11-17)15-6-4-3-5-7-15/h3-14,20H,1-2H3
InChIKey DGOKHTOWUIODOZ-UHFFFAOYSA-N
Instrument Name Agilent 7890A-5975C VL MSD
Ionization Type EI
Literature Reference DOI 10.1002/anie.202016268
Molecular Weight 326.885 g/mol
SMILES c1(C(c2ccc(s2)Cl)C(C)C)ccc(cc1)-c1ccccc1
SPLASH splash10-001i-0090000000-e2f66bcd1a6ce8687a98
Source of Spectrum ACI-60-SM29-4i
Wiley ID 1880274